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298-36-2

298-36-2 structural image
Product Name: 5A-PREGNAN-21-OL-3-20-DIONE CRYSTALLINE
Formula: C21H32O3
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COMPUTED DESCRIPTORS

Molecular Weight 332.5 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 332.23514488 g/mol
Monoisotopic Mass 332.23514488 g/mol
Topological Polar Surface Area 54.4 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 555
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

5alpha-dihydrodeoxycorticosterone is a 3-oxo-5alpha-steroid formed from 11-deoxycorticosterone by reduction across the C4-C5 double bond. It has a role as a progesterone receptor agonist, a GABA modulator and an anticonvulsant. It is a 21-hydroxy steroid, a 3-oxo-5alpha-steroid, a 20-oxo steroid, a primary alpha-hydroxy ketone and a mineralocorticoid. It is functionally related to an 11-deoxycorticosterone. It derives from a hydride of a 5alpha-pregnane.